3,5-bis{[(2,4-dichlorophenyl)methyl]sulfanyl}-4H-1,2,4-triazol-4-amine
Chemical Structure Depiction of
3,5-bis{[(2,4-dichlorophenyl)methyl]sulfanyl}-4H-1,2,4-triazol-4-amine
3,5-bis{[(2,4-dichlorophenyl)methyl]sulfanyl}-4H-1,2,4-triazol-4-amine
Compound characteristics
| Compound ID: | 8014-2048 |
| Compound Name: | 3,5-bis{[(2,4-dichlorophenyl)methyl]sulfanyl}-4H-1,2,4-triazol-4-amine |
| Molecular Weight: | 466.24 |
| Molecular Formula: | C16 H12 Cl4 N4 S2 |
| Smiles: | C(c1ccc(cc1[Cl])[Cl])Sc1nnc(n1N)SCc1ccc(cc1[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.3392 |
| logD: | 6.3392 |
| logSw: | -6.5481 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.721 |
| InChI Key: | XSKBBTWRTPDECC-UHFFFAOYSA-N |